Methyl diacetoacetate

Modify Date: 2025-08-25 16:39:43

Methyl diacetoacetate Structure
Methyl diacetoacetate structure
Common Name Methyl diacetoacetate
CAS Number 4619-66-3 Molecular Weight 188.22100
Density 1.112g/cm3 Boiling Point 209ºC at 760 mmHg
Molecular Formula C9H16O4 Melting Point N/A
MSDS N/A Flash Point 82.4ºC

 Names

Name methyl 2-acetyl-3-oxobutanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.112g/cm3
Boiling Point 209ºC at 760 mmHg
Molecular Formula C9H16O4
Molecular Weight 188.22100
Flash Point 82.4ºC
Exact Mass 188.10500
PSA 60.44000
LogP 1.12390
Index of Refraction 1.423

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AK4900000
CHEMICAL NAME :
Acetoacetic acid, 2-acetyl-, methyl ester
CAS REGISTRY NUMBER :
4619-66-3
BEILSTEIN REFERENCE NO. :
1706278
LAST UPDATED :
199712
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C7-H10-O4
MOLECULAR WEIGHT :
158.17
WISWESSER LINE NOTATION :
1VYV1&VO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Open irritation test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
JIHTAB Journal of Industrial Hygiene and Toxicology. (Cambridge, MA) V.18-31, 1936-49. For publisher information, see AEHLAU. Volume(issue)/page/year: 30,63,1948
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
AJOPAA American Journal of Ophthalmology. (Ophthalmic Pub. Co., 435 N. Michigan Ave., Suite 1415, Chicago, IL 60611) Series 3: V.1- 1918- Volume(issue)/page/year: 29,1363,1946
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,729,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1700 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JIHTAB Journal of Industrial Hygiene and Toxicology. (Cambridge, MA) V.18-31, 1936-49. For publisher information, see AEHLAU. Volume(issue)/page/year: 30,63,1948

 Safety Information

HS Code 2918300090

 Synthetic Route

~10%

Methyl diacetoacetate Structure

Methyl diacetoa...

CAS#:4619-66-3

Literature: Beckman, Eric J.; Munshi, Pradip Green Chemistry, 2011 , vol. 13, # 2 p. 376 - 383

~93%

Methyl diacetoacetate Structure

Methyl diacetoa...

CAS#:4619-66-3

Literature: Bingham; Tyman Organic Preparations and Procedures International, 2001 , vol. 33, # 4 p. 357 - 361

~%

Methyl diacetoacetate Structure

Methyl diacetoa...

CAS#:4619-66-3

Literature: Carbide and Carbon Chem. Corp. Patent: US2432499 , 1943 ; Full Text Show Details Chem.Abstr., 1948 , p. 2615

~%

Methyl diacetoacetate Structure

Methyl diacetoa...

CAS#:4619-66-3

Literature: Claisen; Haase Chemische Berichte, 1900 , vol. 33, p. 3781

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Methyl diacetoacetate Structure

Methyl diacetoa...

CAS#:4619-66-3

Literature: Saito,K.; Sato,T. Bulletin of the Chemical Society of Japan, 1979 , vol. 52, p. 3601 - 3605

~%

Methyl diacetoacetate Structure

Methyl diacetoa...

CAS#:4619-66-3

Literature: Claisen; Zedel Justus Liebigs Annalen der Chemie, 1893 , vol. 277, p. 175

 Customs

HS Code 2918300090
Summary 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

 Synonyms

Diacetessigsaeure-methylester
ACETOACETIC ACID,2-ACETYL-,METHYL ESTER
Methyl 2-acetylacetoacetate
2-Acetyl-3-oxo-buttersaeure-methylester
2-acetyl-3-oxo-butyric acid methyl ester
Methyl diacetoacetate
EINECS 225-031-9
diacetoacetic acid methyl ester
Methyl diacetylacetate
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